2-nitro-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 2-nitro-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 2-nitro-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-yl]benzamide CAS Name: 2-nitro-N-[4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolyl]benzamide IUPAC Name: 2-nitro-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 2-nitro-N-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]benzamide Formula: C20H18N4O5S2 MolecularWeight: 458.51072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5S2/c25-19(16-5-1-2-6-18(16)24(26)27)22-20-21-17(13-30-20)14-7-9-15(10-8-14)31(28,29)23-11-3-4-12-23/h1-2,5-10,13H,3-4,11-12H2,(H,21,22,25)